ethynodiol diacetate

Also known as Continuin®, Femulen®, SC-11800, 3beta,17beta-Diacetoxy-19-nor-17alpha-pregn-4-en-20-yne, 3beta, 17beta-Diacetoxy-17alpha-ethynyl-4-oestrene, 19-Nor-17alpha-pregn-4-en-20-yne-3beta,17-diol diacetate, 17alpha-Ethynylestr-4-ene-3beta,17beta-diol acetate, 17alpha-Ethynyl-4-estrene-3beta,17beta-diol diacetate

chemical compound

In the Vinony graph

Within Vinony's link graph, ethynodiol diacetate is referenced by 1,167 other articles, and connects out to DDT, anabolic steroid and nandrolone.

It sits within the topics Acetate esters, Androgens and Chemical articles with multiple CAS registry numbers.

Its subject is documented across 7 Wikipedia language editions.

Chemical data

Formula: C24H32O4
Molecular weight: 384.5 g/mol
IUPAC name: [(3S,8R,9S,10R,13S,14S,17R)-17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
SMILES: CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]4([C@H]([C@@H]3CCC2=C1)CC[C@]4(C#C)OC(=O)C)C
InChIKey: ONKUMRGIYFNPJW-KIEAKMPYSA-N
XLogP: 3.9
Polar surface area: 52.6 Å²
H-bond donors: 0
H-bond acceptors: 4
Formal charge: 0

via PubChem

Drug data · ChEMBL

Max clinical phase: Approved
Molecule type: Small molecule
First approval: 1966
Admin. routes: oral

via ChEMBL · EBI

Research

732 papers

Ethynodiol diacetate.IARC monographs on the evaluation of the carcinogenic risk of chemicals to humans · 1979
Ethynodiol diacetate as a contraceptive.Fertility and sterility · 1974
Ethynodiol diacetate: clinical experience with a new synthetic oral progestin.Fertility and sterility · 1965
Ethynodiol diacetate as a new, highly potent oral inhibitor of ovulation.Science (New York, N.Y.) · 1962
Biocatalytic modifications of ethynodiol diacetate by fungi, anti-proliferative activity, and acetylcholineterase inhibitory of its transformed products.Steroids · 2021

via PubMed

Wikidata facts

Subclass of: steroid
Mass: 384.23006
Has use: medication

Show 5 more facts

Commons category: Etynodiol diacetate
chemical formula: C₂₄H₃₂O₄
canonical SMILES: CC(=O)OC1CCC2C3CCC4(C(C3CCC2=C1)CCC4(C#C)OC(=O)C)C
isomeric SMILES: CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]4([C@H]([C@@H]3CCC2=C1)CC[C@]4(C#C)OC(=O)C)C
medical condition treated: endometriosis

Sources (2)

via Wikidata · CC0